Modern VB representations of CASSCF wave functions and the fully-variational optimization of modern VB wave functions using the CASVB strategy

Advances in Quantum Chemistry

Volumn 32, Issue C, 1998, Pages 51-67

  Cooper, David L ^a   Thorsteinsson, Thorstein ^b   Gerratt, Joseph ^c  

^a UNIVERSITY OF LIVERPOOL   (United Kingdom)

^b UNIVERSITY OF COPENHAGEN   (Denmark)

^c UNIVERSITY OF BRISTOL   (United Kingdom)

Author keywords

benzene; CASSCF; CASVB; FeH; modern VB; polyenes

Indexed keywords

EID: 0002005413     PISSN: 00653276     EISSN: None     Source Type: Book Series    
DOI: 10.1016/S0065-3276(08)60406-2     Document Type: Article

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